{"id":4385,"date":"2025-06-11T16:32:28","date_gmt":"2025-06-11T07:32:28","guid":{"rendered":"https:\/\/matlantis.com\/ja\/?post_type=product&#038;p=4385"},"modified":"2026-10-19T14:36:42","modified_gmt":"2026-10-19T05:36:42","slug":"comparison","status":"publish","type":"product","link":"https:\/\/matlantis.com\/ja\/product\/comparison\/","title":{"rendered":"\u30aa\u30fc\u30d7\u30f3\u30bd\u30fc\u30b9MLIP\u3068\u306e\u6bd4\u8f03"},"content":{"rendered":"\n<div class=\"wp-block-group is-horizontal is-content-justification-center is-layout-flex wp-container-core-group-is-layout-c0f8077a wp-block-group-is-layout-flex\">\n<p class=\"wp-block-paragraph\"><a href=\"#section-01\">OSS-MLIP \u3068\u306e\u6bd4\u8f03\uff08Pt fcc\uff09<\/a><\/p>\n\n\n\n<p class=\"wp-block-paragraph\"><a href=\"#section-02\">SevenNet-Omni \u3068\u306e\u8a73\u7d30\u6bd4\u8f03<\/a><\/p>\n\n\n\n<p class=\"wp-block-paragraph\"><\/p>\n<\/div>\n\n\n\n<script type=\"importmap\">{\"imports\":{\"@wordpress\/interactivity\":\"\/wp-includes\/js\/dist\/script-modules\/interactivity\/index.min.js\"}}<\/script>\n\n\n\n<h2 id=\"section-01\" class=\"wp-block-heading\">OSS-MLIP \u3068\u306e\u6bd4\u8f03\uff08Pt fcc\uff09<\/h2>\n\n\n\n<p class=\"wp-block-paragraph\">\u3053\u3053\u3067\u306fPFP v9 \u3068 OSS\u306e MLIP\u306b\u3064\u3044\u3066\u3001\u8a08\u7b97\u53ef\u80fd\u539f\u5b50\u6570\u3068\u8a08\u7b97\u901f\u5ea6\u3092\u6bd4\u8f03\u3057\u305f\u7d50\u679c\u3092\u7d39\u4ecb\u3057\u307e\u3059\u3002PFP \u306f Matlantis \u4e0a\u3067\u5b9f\u884c\u3057\u3001\u4ed6\u306e MLIP \u306f NVIDIA A100 GPU\uff08GPU \u30e1\u30e2\u30ea 80GB\uff09\u3068 ASE Calculator \u3092\u7528\u3044\u3066\u8a08\u7b97\u3092\u884c\u3063\u3066\u3044\u307e\u3059\u3002Pt \u306e fcc \u69cb\u9020\u306e supercell \u3092\u62e1\u5927\u3057\u3066\u539f\u5b50\u6570\u3092\u5897\u3084\u3057\u3001\u305d\u308c\u305e\u308c\u529b\u306e\u8a08\u7b97\u3092 10 \u56de\u884c\u3063\u305f\u5e73\u5747\u6642\u9593\u3092\u8a08\u7b97\u901f\u5ea6\u3068\u3057\u307e\u3057\u305f\u3002<\/p>\n\n\n\n<p class=\"wp-block-paragraph\">\u305d\u306e\u7d50\u679c\u3001\u540c\u4e00\u539f\u5b50\u6570\u3067\u306e\u8a08\u7b97\u306b\u304a\u3044\u3066 PFP \u306e\u8a08\u7b97\u901f\u5ea6\u304c\u6700\u3082\u901f\u304f\u3001\u539f\u5b50\u6570\u306e\u5897\u52a0\u306b\u5bfe\u3059\u308b\u8a08\u7b97\u6642\u9593\u306e\u5897\u52a0\u3082\u7de9\u3084\u304b\u3067\u3057\u305f\u3002\u4ee5\u4e0b\u306e\u56f3\u3068\u8868\u306f\u305d\u306e\u6bd4\u8f03\u7d50\u679c\u3067\u3059\uff08\u56f3\u306f\u8996\u8a8d\u6027\u306e\u305f\u3081 50,000 \u539f\u5b50\u4ee5\u4e0b\u30015 \u79d2\u4ee5\u4e0b\u306e\u30c7\u30fc\u30bf\u306e\u307f\u8868\u793a\uff09\u3002<\/p>\n\n\n\n<figure data-wp-context=\"{&quot;imageId&quot;:&quot;6ad680460acb2&quot;}\" data-wp-interactive=\"core\/image\" data-wp-key=\"6ad680460acb2\" class=\"wp-block-image aligncenter size-full is-resized wp-lightbox-container\"><img decoding=\"async\" data-wp-class--hide=\"state.isContentHidden\" data-wp-class--show=\"state.isContentVisible\" data-wp-init=\"callbacks.setButtonStyles\" data-wp-on--click=\"actions.showLightbox\" data-wp-on--load=\"callbacks.setButtonStyles\" data-wp-on--pointerdown=\"actions.preloadImage\" data-wp-on--pointerenter=\"actions.preloadImageWithDelay\" data-wp-on--pointerleave=\"actions.cancelPreload\" data-wp-on-window--resize=\"callbacks.setButtonStyles\" src=\"https:\/\/matlantis.com\/wp-content\/uploads\/2026\/10\/pfp_v9_vs_oss_mlips_Pt.png\" alt=\"PFP\u3068OSS-MLIP\u306e\u63a8\u8ad6\u901f\u5ea6\u30d9\u30f3\u30c1\u30de\u30fc\u30af\uff08Pt fcc\uff09\" style=\"width:411px;height:auto\"\/><button\n\t\t\tclass=\"lightbox-trigger\"\n\t\t\ttype=\"button\"\n\t\t\taria-haspopup=\"dialog\"\n\t\t\tdata-wp-bind--aria-label=\"state.thisImage.triggerButtonAriaLabel\"\n\t\t\tdata-wp-init=\"callbacks.initTriggerButton\"\n\t\t\tdata-wp-on--click=\"actions.showLightbox\"\n\t\t\tdata-wp-style--right=\"state.thisImage.buttonRight\"\n\t\t\tdata-wp-style--top=\"state.thisImage.buttonTop\"\n\t\t>\n\t\t\t<svg xmlns=\"http:\/\/www.w3.org\/2000\/svg\" width=\"12\" height=\"12\" fill=\"none\" viewBox=\"0 0 12 12\">\n\t\t\t\t<path fill=\"#fff\" d=\"M2 0a2 2 0 0 0-2 2v2h1.5V2a.5.5 0 0 1 .5-.5h2V0H2Zm2 10.5H2a.5.5 0 0 1-.5-.5V8H0v2a2 2 0 0 0 2 2h2v-1.5ZM8 12v-1.5h2a.5.5 0 0 0 .5-.5V8H12v2a2 2 0 0 1-2 2H8Zm2-12a2 2 0 0 1 2 2v2h-1.5V2a.5.5 0 0 0-.5-.5H8V0h2Z\" \/>\n\t\t\t<\/svg>\n\t\t<\/button><figcaption class=\"wp-element-caption\">\u56f31. PFP\u3068OSS-MLIP\u3068\u306e\u8a08\u7b97\u53ef\u80fd\u539f\u5b50\u6570\u30fb\u901f\u5ea6\u6bd4\u8f03<\/figcaption><\/figure>\n\n\n\n<p class=\"wp-block-paragraph\">\u5404\u30e2\u30c7\u30eb\u306e\u6700\u5927\u8a08\u7b97\u539f\u5b50\u6570\u306f\u4ee5\u4e0b\u306e\u3068\u304a\u308a\u3067\u3059\u3002\u306a\u304a\u3001PFP \u306e\u6700\u5927\u539f\u5b50\u6570\u306f GPU \u30e1\u30e2\u30ea\u4e0d\u8db3\u3067\u306f\u306a\u304f Matlantis \u304c\u53d7\u3051\u4ed8\u3051\u308b\u7cfb\u30b5\u30a4\u30ba\u306e\u4e0a\u9650\u306b\u3088\u308b\u3082\u306e\u3067\u3059\uff08\u3053\u306e\u4e0a\u9650\u306f\u5951\u7d04\u30d7\u30e9\u30f3\u306b\u3088\u3063\u3066\u7570\u306a\u308a\u307e\u3059\uff09\u3002UMA-S \u306f PFP \u3088\u308a\u5927\u304d\u306a\u7cfb\u3092\u6271\u3048\u307e\u3059\u304c\u3001\u7d04 30,000 \u539f\u5b50\u3067\u306e\u901f\u5ea6\u306f\u305d\u308c\u305e\u308c PFP \u306e 1\/6 \u7a0b\u5ea6\u3067\u3059\u3002<\/p>\n\n\n\n<h4 class=\"wp-block-heading\"><strong>\u88681. \u30e2\u30c7\u30eb\u3054\u3068\u306e\u8a08\u7b97\u53ef\u80fd\u306a\u6700\u5927\u539f\u5b50\u6570<\/strong><\/h4>\n\n\n\n<style>\n.mt-bench{overflow-x:auto;margin:0 0 2em;}\n.mt-bench table{width:100%;border-collapse:collapse !important;border:none !important;font-size:15px;line-height:1.4;}\n.mt-bench th,.mt-bench td{border:none !important;background:none !important;padding:.75em 1em !important;vertical-align:middle;text-align:center;}\n.mt-bench thead tr:first-child th:first-child,.mt-bench td:first-child{text-align:left;}\n.mt-bench thead{border-top:2px solid #999 !important;border-bottom:2px solid #999 !important;}\n.mt-bench th{font-weight:bold;}\n.mt-bench tbody tr+tr td{border-top:1px solid #ddd !important;}\n.mt-bench tbody{border-bottom:2px solid #999 !important;}\n.mt-bench .mt-group{position:relative;}\n.mt-bench .mt-group::after{content:\"\";position:absolute;left:1em;right:1em;bottom:0;border-bottom:1px solid #ccc;}\n.mt-bench-1{max-width:720px;margin-left:auto;margin-right:auto;}\n.mt-bench-2 table{min-width:640px;}\n<\/style>\n<div class=\"mt-bench mt-bench-1\"><table><thead><tr><th>Model (environment)<\/th><th>Max. atoms<\/th><\/tr><\/thead><tbody><tr><td>PFP v9 (Matlantis)<\/td><td>42,875<\/td><\/tr><tr><td>SevenNet-Omni (A100)<\/td><td>19,683<\/td><\/tr><tr><td>UMA-S (A100)<\/td><td>97,336<\/td><\/tr><tr><td>MACE-MPA-0 (A100)<\/td><td>13,824<\/td><\/tr><tr><td>MatterSim-v1-5M (A100)<\/td><td>10,648<\/td><\/tr><tr><td>CHGNet (A100)<\/td><td>4,913<\/td><\/tr><tr><td>eqV2-31M OMat MPtrj-sAlex (A100)<\/td><td>1,728<\/td><\/tr><tr><td>Orb-v3 cons-inf-omat (A100)<\/td><td>10,648<\/td><\/tr><\/tbody><\/table><\/div>\n\n\n\n<h2 id=\"section-02\" class=\"wp-block-heading\">SevenNet-Omni \u3068\u306e\u8a73\u7d30\u6bd4\u8f03<\/h2>\n\n\n\n<p class=\"wp-block-paragraph\">r\u00b2SCAN \u6c4e\u95a2\u6570\u3067\u5b66\u7fd2\u3055\u308c\u305f\u516c\u958b uMLIP \u3067\u3042\u308b SevenNet-Omni\uff08matpes_r2scan \u30bf\u30b9\u30af\uff09\u3068 PFP \u306e r\u00b2SCAN \u8a08\u7b97\u30e2\u30fc\u30c9\uff08\u4ee5\u4e0b PFP-R2SCAN\uff09\u3092\u3001Pt fcc\u3001LiH \u5ca9\u5869\u578b\u69cb\u9020\uff08\u683c\u5b50\u5b9a\u6570 4.083 \u00c5\uff09\u3001\u6db2\u4f53\u6c34\uff088 \u5206\u5b50\u306e\u7acb\u65b9\u4f53\u30bb\u30eb\uff09\u306e 3 \u7cfb\u3067\u8a73\u3057\u304f\u6bd4\u8f03\u3057\u307e\u3057\u305f\u3002\u8a08\u7b97\u6761\u4ef6\u306f\u4e0a\u8a18\u3068\u540c\u4e00\u3067\u3059\u3002<\/p>\n\n\n\n<p class=\"wp-block-paragraph\">\u5404\u7cfb\u3067 SevenNet-Omni \u304c\u8a08\u7b97\u3067\u304d\u305f\u6700\u5927\u30b5\u30a4\u30ba\uff08\u7cfb\u540d\u306e\u4e0b\u306b\u8a18\u8f09\uff09\u306b\u304a\u3051\u308b\u3001\u529b\u306e\u63a8\u8ad6\u306b\u8981\u3057\u305f\u6642\u9593\u3092\u4ee5\u4e0b\u306e\u8868\u306b\u307e\u3068\u3081\u307e\u3057\u305f\u30023 \u7cfb\u3059\u3079\u3066\u3067 PFP-R2SCAN \u306e\u6700\u5927\u8a08\u7b97\u539f\u5b50\u6570\u306f SevenNet-Omni \u306e\u7d04 2 \u500d\u3001\u540c\u4e00\u30b5\u30a4\u30ba\u3067\u306e\u529b\u8a08\u7b97\u3082\u9ad8\u901f\u3067\u3001\u5dee\u304c\u6700\u3082\u5927\u304d\u3044\u6db2\u4f53\u306e\u6c34\u3067\u306f 12,288 \u539f\u5b50\u3067\u7d04 2.4 \u500d\u306e\u901f\u5ea6\u5dee\u304c\u3042\u308a\u307e\u3057\u305f\u3002\u307e\u305f\u3001\u6570\u5bc6\u5ea6\u304c\u9ad8\u3044\u7cfb\u306e\u65b9\u304c\u51e6\u7406\u6642\u9593\u304c\u5897\u3048\u308b\u50be\u5411\u306b\u3042\u308a\u307e\u3059\u3002<\/p>\n\n\n\n<h4 class=\"wp-block-heading\"><strong>\u88682. PFP\u3068SevenNet-Omni\u306b\u95a2\u3059\u308b\u8a73\u7d30\u306a\u901f\u5ea6\u30d9\u30f3\u30c1\u30de\u30fc\u30af\u306e\u7d50\u679c<\/strong><\/h4>\n\n\n\n<div class=\"mt-bench mt-bench-2\"><table><thead><tr><th rowspan=\"2\" style=\"vertical-align:bottom;\">System<\/th><th colspan=\"2\" class=\"mt-group\">Max. atoms<\/th><th colspan=\"2\" class=\"mt-group\">Time per force evaluation (s\/step)<\/th><\/tr><tr><th>PFP-R2SCAN<br>(Matlantis)<\/th><th>SevenNet-Omni<br>(A100)<\/th><th>PFP-R2SCAN<br>(Matlantis)<\/th><th>SevenNet-Omni<br>(A100)<\/th><\/tr><\/thead><tbody><tr><td>Pt fcc<br>(at 19,683 atoms)<\/td><td>44,100<\/td><td>19,683<\/td><td>1.29<\/td><td>1.99<\/td><\/tr><tr><td>LiH rocksalt<br>(at 11,664 atoms)<\/td><td>24,334<\/td><td>11,664<\/td><td>0.89<\/td><td>1.90<\/td><\/tr><tr><td>Liquid water<br>(at 12,288 atoms)<\/td><td>29,040<\/td><td>12,288<\/td><td>0.70<\/td><td>1.68<\/td><\/tr><\/tbody><\/table><\/div>\n\n\n\n<p class=\"wp-block-paragraph\">\u3053\u306e\u7d50\u679c\u306f\u3001PFP \u3092\u7528\u3044\u308b\u3053\u3068\u3067\u3001OSS-MLIP\u3068\u6bd4\u8f03\u3057\u3066\u5927\u898f\u6a21\u306a\u7cfb\u306e\u30b7\u30df\u30e5\u30ec\u30fc\u30b7\u30e7\u30f3\u3084\u3001\u51dd\u96c6\u7cfb\u306a\u3069\u306e\u9577\u6642\u9593\u306e\u30b7\u30df\u30e5\u30ec\u30fc\u30b7\u30e7\u30f3\u304c\u5b9f\u884c\u53ef\u80fd\u306b\u306a\u308b\u3053\u3068\u3092\u793a\u5506\u3057\u3066\u3044\u307e\u3059\u3002\u3053\u308c\u306b\u3088\u308a\u3001\u8907\u96d1\u306a\u73fe\u8c61\u306e\u89e3\u660e\u3084\u7cbe\u5ea6\u306e\u9ad8\u3044\u7269\u6027\u8a08\u7b97\u304c\u9032\u5c55\u3059\u308b\u3068\u671f\u5f85\u3055\u308c\u307e\u3059\u3002<\/p>\n","protected":false},"featured_media":7541,"template":"","meta":{"_acf_changed":false},"class_list":["post-4385","product","type-product","status-publish","has-post-thumbnail","hentry"],"acf":[],"_links":{"self":[{"href":"https:\/\/matlantis.com\/ja\/wp-json\/wp\/v2\/product\/4385","targetHints":{"allow":["GET"]}}],"collection":[{"href":"https:\/\/matlantis.com\/ja\/wp-json\/wp\/v2\/product"}],"about":[{"href":"https:\/\/matlantis.com\/ja\/wp-json\/wp\/v2\/types\/product"}],"wp:featuredmedia":[{"embeddable":true,"href":"https:\/\/matlantis.com\/ja\/wp-json\/wp\/v2\/media\/7541"}],"wp:attachment":[{"href":"https:\/\/matlantis.com\/ja\/wp-json\/wp\/v2\/media?parent=4385"}],"curies":[{"name":"wp","href":"https:\/\/api.w.org\/{rel}","templated":true}]}}